SCHEMBL24418019

SCHEMBL24418019

Ic1ncc2n1CCNCC2

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.40
HTR2C P28335 3/20 0.40
CHRNB2 P17787 2/20 0.33
CHRNA4 P43681 2/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
ADRB2 P07550 1/20 0.31
PLD1 Q13393 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL213339 0.68
SCHEMBL15001582 0.63 HTR2A (0.41) HTR2AHTR2CCHRNB2CHRNA4KDM4E
SCHEMBL343286 0.62 ADRB2 (0.36) HTR2AHTR2CCHRNB2CHRNA4KDM4E
SCHEMBL24722874 0.62 HTR2C (0.39) HTR2AHTR2CCHRNB2CHRNA4KDM4E
SCHEMBL5779110 0.60 HTR2A (0.39) HTR2AHTR2CCHRNB2CHRNA4
SCHEMBL2002227 0.60 HTR2C (0.39) HTR2AHTR2CCHRNB2CHRNA4
SCHEMBL25034229 0.59 HTR2C (0.47) HTR2AHTR2CCHRNB2CHRNA4KDM4E
SCHEMBL24417833 0.59 HTR2C (0.37) HTR2AHTR2C
SCHEMBL20517214 0.59 HTR2C (0.37) HTR2AHTR2CCHRNB2CHRNA4
Hydrochloric Acid SCHEMBL5774503 0.59 HTR2C (0.38) HTR2AHTR2CCHRNB2CHRNA4KDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220143042-A1 FUSED GLYCOSIDASE INHIBITORS ASCENEURON SA (CH) 2022-05-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220143042-A1 FUSED GLYCOSIDASE INHIBITORS BACE1, ENGASE, GBA3 HTR2A 3672/4885HTR2C 4513/4885CHRNB2 445/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.